Project name: d15784b8928fd37

Chain sequence(s)	B: AELAALRAQLKGAAEAYKLMLEVAKQLGLDTEKIEKKTKERIERIKKIIE
Selected Chain(s)	B
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:00)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with B chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:38)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:38)

• Minimal score value: -5.7188
• Maximal score value: 0.7231
• Average score: -1.9242
• Total score value: -96.2077

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index	residue name	chain	Aggrescan3D score	mutation
1	A	B	-0.2652
2	E	B	-0.8706
3	L	B	0.7231
4	A	B	0.1632
5	A	B	-0.3334
6	L	B	0.0167
7	R	B	-0.9719
8	A	B	-1.1527
9	Q	B	-1.6586
10	L	B	-1.5115
11	K	B	-2.6840
12	G	B	-2.1043
13	A	B	-1.6270
14	A	B	-2.5839
15	E	B	-2.2014
16	A	B	-0.7963
17	Y	B	-1.1233
18	K	B	-1.3514
19	L	B	0.1947
20	M	B	0.3843
21	L	B	0.0000
22	E	B	-1.8016
23	V	B	-0.0393
24	A	B	0.0000
25	K	B	-2.3360
26	Q	B	-1.3258
27	L	B	0.2543
28	G	B	-0.6825
29	L	B	-0.2441
30	D	B	-2.3687
31	T	B	-2.9439
32	E	B	-4.0635
33	K	B	-4.0944
34	I	B	-2.9397
35	E	B	-4.7582
36	K	B	-5.1142
37	K	B	-4.9991
38	T	B	0.0000
39	K	B	-5.3399
40	E	B	-5.7188
41	R	B	-5.3575
42	I	B	0.0000
43	E	B	-4.9820
44	R	B	-4.3351
45	I	B	-3.0759
46	K	B	-3.7224
47	K	B	-3.0237
48	I	B	-0.3782
49	I	B	-1.0080
50	E	B	-2.0560